![6-(1-Methyl-3-phenyl-propyl)pyrrolo[3,4-b]pyridine-5,7-dione](/api/spectrum/C7GSEBZM7g8/structure.png?h=300&w=458 "6-(1-Methyl-3-phenyl-propyl)pyrrolo[3,4-b]pyridine-5,7-dione")
| SpectraBase Compound ID | KVGZzp3CCyd |
|---|---|
| InChI | InChI=1S/C17H16N2O2/c1-12(9-10-13-6-3-2-4-7-13)19-16(20)14-8-5-11-18-15(14)17(19)21/h2-8,11-12H,9-10H2,1H3 |
| InChIKey | JIGIBFLTRRGOMB-UHFFFAOYSA-N |
| Mol Weight | 280.33 g/mol |
| Molecular Formula | C17H16N2O2 |
| Exact Mass | 280.121178 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C7GSEBZM7g8 |
|---|---|
| Name | 6-(1-Methyl-3-phenyl-propyl)pyrrolo[3,4-B]pyridine-5,7-dione |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.121177761 u |
| Formula | C17H16N2O2 |
| InChI | InChI=1S/C17H16N2O2/c1-12(9-10-13-6-3-2-4-7-13)19-16(20)14-8-5-11-18-15(14)17(19)21/h2-8,11-12H,9-10H2,1H3 |
| InChIKey | JIGIBFLTRRGOMB-UHFFFAOYSA-N |
| SMILES | C1=2C(=CC=CN2)C(N(C1=O)C(C)CCC=1C=CC=CC1)=O |